SCHEMBL16899230

SCHEMBL16899230

Cc1nn(C)c2cc(N3CCC(CO[Si](C)(C)C(C)(C)C)CC3)c(N)cc12

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 1/20 0.36
▸ ADORA2B P29275 1/20 0.36
▸ LGMN Q99538 2/20 0.31
▸ DCPS Q96C86 1/20 0.31
▸ FKBP1A P62942 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL17373906 0.96 ADORA2A (0.36) ADORA2AADORA2BFKBP1A
SCHEMBL16898820 0.88 SCN9A (0.32) ADORA2AADORA2BFKBP1A
SCHEMBL16898657 0.84 SMN1; SMN2 (0.40) —
SCHEMBL16898947 0.84 ADORA2A (0.38) ADORA2AADORA2BLGMN
SCHEMBL18889901 0.82 SMN1; SMN2 (0.40) ADORA2AADORA2B
SCHEMBL16898670 0.82 DCPS (0.33) DCPSFKBP1A
SCHEMBL16899043 0.77 KDM4E (0.33) DCPSFKBP1A
SCHEMBL360375 0.75 POLB (0.48) DCPS
SCHEMBL16899263 0.75 FKBP1A (0.31) FKBP1A
SCHEMBL16898762 0.74 IRAK4 (0.32) DCPSFKBP1A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3092226-B1 INDAZOLE COMPOUNDS AS IRAK4 INHIBITORS AURIGENE DISCOVERY TECH LTD (IN) 2019-03-13 — — EP disclosed
US-10160753-B2 Indazole compounds as IRAK4 inhibitors AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2018-12-25 — — US disclosed
US-20180201609-A1 INDAZOLE AND AZAINDAZOLE COMPOUNDS AS IRAK-4 INHIBITORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2018-07-19 — — US disclosed
EP-3322698-A1 INDAZOLE AND AZAINDAZOLE COMPOUNDS AS IRAK-4 INHIBITORS Aurigene Discovery Technologies Limited (IN) 2018-05-23 — — EP disclosed
WO-2017009798-A1 INDAZOLE AND AZAINDAZOLE COMPOUNDS AS IRAK-4 INHIBITORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2017-01-19 — — WO disclosed
EP-3092226-A1 INDAZOLE COMPOUNDS AS IRAK4 INHIBITORS Aurigene Discovery Technologies Limited (IN) 2016-11-16 — — EP disclosed
US-20160326151-A1 Indazole Compounds as IRAK4 Inhibitors AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2016-11-10 — — US disclosed
WO-2015104662-A1 INDAZOLE COMPOUNDS AS IRAK4 INHIBITORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2015-07-16 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180201609-A1 INDAZOLE AND AZAINDAZOLE COMPOUNDS AS IRAK-4 INHIBITORS IRAK4, IRAK3, IRAK2 ADORA2A 2870/4885ADORA2B 3302/4885LGMN 4839/4885
US-10160753-B2 Indazole compounds as IRAK4 inhibitors IRAK4, IRAK3, IRAK1 ADORA2A 2938/4885ADORA2B 2902/4885LGMN 4648/4885
US-20160326151-A1 Indazole Compounds as IRAK4 Inhibitors IRAK4, IRAK3, IRAK1 ADORA2A 2938/4885ADORA2B 2902/4885LGMN 4648/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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